4-[(3-bromophenyl)methyl]-2-methyl-1H-pyrazol-2-ium-3-amine

Systemtic Name: 4-[(3-bromophenyl)methyl]-2-methyl-1H-pyrazol-2-ium-3-amine Openeye Name: 4-[(3-bromophenyl)methyl]-2-methyl-1H-pyrazol-2-ium-3-amine CAS Name: 4-[(3-bromophenyl)methyl]-2-methyl-1H-pyrazol-2-ium-3-amine IUPAC Name: 4-[(3-bromophenyl)methyl]-2-methyl-1H-pyrazol-2-ium-3-amine Traditional Name: [4-(3-bromobenzyl)-2-methyl-1H-pyrazol-2-ium-3-yl]amine Formula: C11H13BrN3+ MolecularWeight: 267.14502

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(C(=CN1)CC2=CC(=CC=C2)Br)N

Isomeric SMILES

C[N+]1=C(C(=CN1)CC2=CC(=CC=C2)Br)N

InChI

InChI=1S/C11H12BrN3/c1-15-11(13)9(7-14-15)5-8-3-2-4-10(12)6-8/h2-4,6-7H,5H2,1H3,(H2,13,14)/p+1